(3R)-3-(3,3-dimethylbutylazaniumyl)-4-[[(2R)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: (3R)-3-(3,3-dimethylbutylazaniumyl)-4-[[(2R)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: (3R)-4-[[(1R)-1-benzyl-2-methoxy-2-oxo-ethyl]amino]-3-(3,3-dimethylbutylammonio)-4-oxo-butanoate CAS Name: (3R)-3-(3,3-dimethylbutylammonio)-4-[[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoate IUPAC Name: (3R)-3-(3,3-dimethylbutylazaniumyl)-4-[[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoate Traditional Name: (3R)-4-[[(1R)-1-benzyl-2-keto-2-methoxy-ethyl]amino]-3-(3,3-dimethylbutylammonio)-4-keto-butyrate Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC[NH2+]C(CC(=O)[O-])C(=O)NC(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)CC[NH2+][C@H](CC(=O)[O-])C(=O)N[C@H](CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C20H30N2O5/c1-20(2,3)10-11-21-15(13-17(23)24)18(25)22-16(19(26)27-4)12-14-8-6-5-7-9-14/h5-9,15-16,21H,10-13H2,1-4H3,(H,22,25)(H,23,24)/t15-,16-/m1/s1